HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=531",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=529",
"results": [
{
"id": "jvasp-100708",
"created_at": "2022-09-04T14:36:42.148602Z",
"updated_at": "2022-09-04T14:36:42.148627Z",
"structure_string": "Ag1 Ge3\n1.0\n3.813608 -0.258688 -3.363198\n-0.947017 3.703199 -3.363198\n0.215285 0.258688 5.080193\nAg Ge\n1 3\ndirect\n0.000000 0.000000 0.000000 Ag\n0.750000 0.250000 0.499999 Ge\n0.249999 0.750000 0.499999 Ge\n0.500000 0.500000 -0.000001 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Ge"
],
"chemical_system": "Ag-Ge",
"density": 6.979435585779646,
"density_atomic": 0.05160548299471023,
"volume": 77.51114354282889,
"volume_molar": 11.669575422087018,
"formula_full": "Ag1 Ge3",
"formula_reduced": "AgGe3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6031462774999999,
"spacegroup": 139
},
{
"id": "jvasp-15031",
"created_at": "2022-09-04T14:36:46.028749Z",
"updated_at": "2022-09-04T14:36:46.028770Z",
"structure_string": "Tb1 Sb1\n1.0\n3.800759 0.000000 2.194369\n1.266920 3.583390 2.194369\n0.000000 0.000000 4.388739\nTb Sb\n1 1\ndirect\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tb",
"Sb"
],
"chemical_system": "Sb-Tb",
"density": 7.79766690470082,
"density_atomic": 0.03345999192044027,
"volume": 59.77287755345292,
"volume_molar": 17.998034112856896,
"formula_full": "Tb1 Sb1",
"formula_reduced": "TbSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.4166372499999999,
"spacegroup": 225
},
{
"id": "jvasp-12196",
"created_at": "2022-09-04T14:36:41.946954Z",
"updated_at": "2022-09-04T14:36:41.946975Z",
"structure_string": "Cr2 O4\n1.0\n-2.503337 -1.459588 0.001167\n0.008108 2.862897 -0.445767\n-0.807485 1.395814 -9.292736\nCr O\n2 4\ndirect\n0.997438 -0.001490 0.502102 Cr\n0.998120 0.000967 0.002051 Cr\n0.732784 0.469851 0.395234 O\n0.596168 0.196432 0.108796 O\n0.262117 0.527218 0.608967 O\n0.400054 0.805459 0.895308 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 4.330979105985844,
"density_atomic": 0.09315481944932018,
"volume": 64.40890589954105,
"volume_molar": 6.464658292077178,
"formula_full": "Cr2 O4",
"formula_reduced": "CrO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.212008133333333,
"spacegroup": 166
},
{
"id": "jvasp-100510",
"created_at": "2022-09-04T14:37:00.795677Z",
"updated_at": "2022-09-04T14:37:00.795700Z",
"structure_string": "Ti3 Cd1\n1.0\n4.130000 0.000000 0.000000\n0.000000 4.130000 0.000000\n-0.000000 -0.000000 4.130000\nTi Cd\n3 1\ndirect\n0.000000 0.500000 0.500000 Ti\n0.500000 0.000000 0.500000 Ti\n0.500000 0.500000 0.000000 Ti\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Cd"
],
"chemical_system": "Cd-Ti",
"density": 6.034749742673695,
"density_atomic": 0.056781888996318655,
"volume": 70.44499699999999,
"volume_molar": 10.605742194294441,
"formula_full": "Ti3 Cd1",
"formula_reduced": "Ti3Cd",
"formula_anonymous": "AB3",
"energy_above_hull": 2.4009786875000003,
"spacegroup": 221
},
{
"id": "jvasp-8821",
"created_at": "2022-09-04T14:36:46.068598Z",
"updated_at": "2022-09-04T14:36:46.068627Z",
"structure_string": "Bi1 Te3\n1.0\n8.727156 -0.333078 -0.198178\n7.826107 3.876370 -0.198178\n7.826107 1.675209 3.501313\nBi Te\n1 3\ndirect\n0.392717 0.392717 0.392715 Bi\n0.223368 0.223368 0.223367 Te\n0.977910 0.977909 0.977906 Te\n0.804509 0.804509 0.804506 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Bi",
"Te"
],
"chemical_system": "Bi-Te",
"density": 7.3114007016544384,
"density_atomic": 0.029761231830822188,
"volume": 134.40303891781133,
"volume_molar": 20.23485047337045,
"formula_full": "Bi1 Te3",
"formula_reduced": "BiTe3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9186444,
"spacegroup": 160
},
{
"id": "jvasp-18925",
"created_at": "2022-09-04T14:36:41.964648Z",
"updated_at": "2022-09-04T14:36:41.964672Z",
"structure_string": "Be5 Pd1\n1.0\n3.668853 -0.000000 2.118213\n1.222951 3.459027 2.118213\n0.000000 0.000000 4.236426\nBe Pd\n5 1\ndirect\n0.250000 0.250000 0.250000 Be\n0.624779 0.624780 0.624780 Be\n0.624779 0.624780 0.125660 Be\n0.125660 0.624780 0.624780 Be\n0.624779 0.125660 0.624780 Be\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Be",
"Pd"
],
"chemical_system": "Be-Pd",
"density": 4.678677548616924,
"density_atomic": 0.11160081403587989,
"volume": 53.76304870026296,
"volume_molar": 5.39614411599531,
"formula_full": "Be5 Pd1",
"formula_reduced": "Be5Pd",
"formula_anonymous": "AB5",
"energy_above_hull": 1.9569143666666668,
"spacegroup": 216
},
{
"id": "jvasp-12908",
"created_at": "2022-09-04T14:36:41.081514Z",
"updated_at": "2022-09-04T14:36:41.081535Z",
"structure_string": "B12 P2\n1.0\n4.922957 -0.000860 1.828133\n1.270949 4.756069 1.828133\n-0.001120 -0.000860 5.251435\nB P\n12 2\ndirect\n0.183803 0.717797 0.183802 B\n0.183803 0.183802 0.717797 B\n0.717797 0.183802 0.183802 B\n0.282204 0.816198 0.816197 B\n0.816198 0.282203 0.816197 B\n0.816198 0.816198 0.282202 B\n0.012766 0.326752 0.012766 B\n0.012766 0.012766 0.326752 B\n0.326752 0.012766 0.012766 B\n0.673249 0.987234 0.987234 B\n0.987235 0.673248 0.987234 B\n0.987235 0.987234 0.673247 B\n0.404669 0.404668 0.404668 P\n0.595332 0.595332 0.595331 P\n",
"nsites": 14,
"nelements": 2,
"elements": [
"B",
"P"
],
"chemical_system": "B-P",
"density": 2.58819912900716,
"density_atomic": 0.11384157686685213,
"volume": 122.97791707834693,
"volume_molar": 5.289930907267237,
"formula_full": "B12 P2",
"formula_reduced": "B6P",
"formula_anonymous": "AB6",
"energy_above_hull": 4.819624428571428,
"spacegroup": 166
},
{
"id": "jvasp-19829",
"created_at": "2022-09-04T14:36:46.079384Z",
"updated_at": "2022-09-04T14:36:46.079404Z",
"structure_string": "Fe6 P3\n1.0\n2.899407 -5.021920 -0.000000\n2.899407 5.021920 0.000000\n-0.000000 -0.000000 3.447491\nFe P\n6 3\ndirect\n0.000000 0.407594 0.500000 Fe\n0.592407 0.592407 0.500000 Fe\n0.407594 0.000000 0.500000 Fe\n0.742621 0.000000 0.000000 Fe\n0.257379 0.257379 0.000000 Fe\n0.000000 0.742621 0.000000 Fe\n0.666668 0.333334 0.000000 P\n0.333334 0.666668 0.000000 P\n0.000000 0.000000 0.500000 P\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Fe",
"P"
],
"chemical_system": "Fe-P",
"density": 7.079000032976111,
"density_atomic": 0.08964589336994853,
"volume": 100.39500596930877,
"volume_molar": 6.717698417202419,
"formula_full": "Fe6 P3",
"formula_reduced": "Fe2P",
"formula_anonymous": "AB2",
"energy_above_hull": 2.7695021666666664,
"spacegroup": 189
},
{
"id": "jvasp-79066",
"created_at": "2022-09-04T14:37:02.052085Z",
"updated_at": "2022-09-04T14:37:02.052107Z",
"structure_string": "Np1 Mn3\n1.0\n3.723496 -0.000005 -0.000000\n-0.000005 3.723437 0.000001\n-0.000000 0.000001 3.723507\nNp Mn\n1 3\ndirect\n-0.000000 -0.000000 1.000000 Np\n-0.000001 0.499998 0.499998 Mn\n0.499997 0.999999 0.499999 Mn\n0.499998 0.499999 -0.000000 Mn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Np",
"Mn"
],
"chemical_system": "Mn-Np",
"density": 12.924901184126455,
"density_atomic": 0.07748415746180606,
"volume": 51.62345608483519,
"volume_molar": 7.772092976513901,
"formula_full": "Np1 Mn3",
"formula_reduced": "NpMn3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.978150431034482,
"spacegroup": 221
},
{
"id": "jvasp-22634",
"created_at": "2022-09-04T14:37:01.502165Z",
"updated_at": "2022-09-04T14:37:01.502207Z",
"structure_string": "P6 N10\n1.0\n4.934097 0.005087 -1.011355\n-1.832268 4.594187 -0.951010\n0.003316 -0.009091 8.806337\nP N\n6 10\ndirect\n0.231504 0.481503 0.750001 P\n0.374893 0.661964 0.444281 P\n0.282319 0.069389 0.944281 P\n0.625109 0.338038 0.555720 P\n0.717682 0.930613 0.055720 P\n0.768498 0.518498 0.250001 P\n0.612379 0.500883 0.400597 N\n0.299983 0.227580 0.807321 N\n0.387622 0.499118 0.599404 N\n0.600286 0.211783 0.099404 N\n0.920260 0.492663 0.692680 N\n0.700018 0.772422 0.192680 N\n0.500001 0.000000 0.500001 N\n0.399715 0.788218 0.900597 N\n0.079741 0.507339 0.307321 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 16,
"nelements": 2,
"elements": [
"P",
"N"
],
"chemical_system": "N-P",
"density": 2.7105159432376444,
"density_atomic": 0.08013564473297363,
"volume": 199.66146217847097,
"volume_molar": 7.514933934913554,
"formula_full": "P6 N10",
"formula_reduced": "P3N5",
"formula_anonymous": "A3B5",
"energy_above_hull": 5.01392034375,
"spacegroup": 15
},
{
"id": "jvasp-7991",
"created_at": "2022-09-04T14:37:00.789292Z",
"updated_at": "2022-09-04T14:37:00.789313Z",
"structure_string": "Zn1 O1\n1.0\n2.646722 0.000000 1.528085\n0.882241 2.495353 1.528085\n0.000000 0.000000 3.056171\nZn O\n1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.499999 0.500002 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zn",
"O"
],
"chemical_system": "O-Zn",
"density": 6.697309173178576,
"density_atomic": 0.09908593847332345,
"volume": 20.184498737310268,
"volume_molar": 6.077694628306235,
"formula_full": "Zn1 O1",
"formula_reduced": "ZnO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0636099999999999,
"spacegroup": 225
},
{
"id": "jvasp-18926",
"created_at": "2022-09-04T14:36:40.998002Z",
"updated_at": "2022-09-04T14:36:40.998029Z",
"structure_string": "Lu1 S1\n1.0\n3.287235 -0.000000 1.897886\n1.095745 3.099235 1.897886\n0.000000 0.000000 3.795772\nLu S\n1 1\ndirect\n0.000000 0.000000 0.000000 Lu\n0.499998 0.500001 0.500001 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Lu",
"S"
],
"chemical_system": "Lu-S",
"density": 8.889988454374993,
"density_atomic": 0.051718344840915614,
"volume": 38.670997808455624,
"volume_molar": 11.644109606608563,
"formula_full": "Lu1 S1",
"formula_reduced": "LuS",
"formula_anonymous": "AB",
"energy_above_hull": 0.0692378750000002,
"spacegroup": 225
}
]
}